Vitas-M small molecule compound
3-[(4-bromobenzyl)sulfanyl]-4,5-bis(4-chlorophenyl)-4H-1,2,4-triazole
Catalog ID
STL354167
SMILES Clc1ccc(cc1)n1c(SCc2ccc(cc2)Br)nnc1c1ccc(cc1)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H14BrCl2N3S MW 491.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrCl2N3S/c22-16-5-1-14(2-6-16)13-28-21-26-25-20(15-3-7-17(23)8-4-15)27(21)19-11-9-18(24)10-12-19/h1-12H,13H2InChIKey
DXKHBAYJXRXIEE-UHFFFAOYSA-NSynonyms
861628-27-53(((4BROMOPHENYL)METHYL)SULFANYL)45BIS(4CHLOROPHENYL)4H124TRIAZOLE
3((4bromobenzyl)sulfanyl)45bis(4chlorophenyl)4H124triazole
3((4bromobenzyl)thio)45bis(4chlorophenyl)4H124triazole
3((4BROMOPHENYL)METHYLSULFANYL)45BIS(4CHLOROPHENYL)124TRIAZOLE
45BIS(4CHLOROPHENYL)3((4BROMOPHENYL)METHYLTHIO)124TRIAZOLE
861628275
C1=CC(=CC=C1CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)Br
InChI=1SC21H14BrCl2N3Sc22165114(2616)132821262520(153717(23)8415)27(21)1911918(24)101219h112H13H2
MFCD05684647
ZINC000009308386
ZINC09308386
ZINC9308386
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